COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673530
Chemical Name: 3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-{3-[3-(diethylamino)phenoxy]-5-nitrophenyl}tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: CCN(c1cccc(c1)Oc1cc(cc(c1)[N+](=O)[O-])NC(=O)C12CC3CC(C1)CC(C2)(C3)n1cnc(n1)Cl)CC

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Molecular Weight: 565.07
Empirical Formula: C29H33ClN6O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.781
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 118
Number of rings: 7

     

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